7BUY

The crystal structure of COVID-19 main protease in complex with carmofur

Summary for 7BUY

Entry DOI	10.2210/pdb7buy/pdb
Descriptor	3C-like proteinase, hexylcarbamic acid, DIMETHYL SULFOXIDE, ... (4 entities in total)
Functional Keywords	covid-2019 virus, main protease, carmofur, viral protein
Biological source	Severe acute respiratory syndrome coronavirus 2 (2019-nCoV)
Total number of polymer chains	1
Total formula weight	34361.41
Authors	Zhao, Y.,Zhang, B.,Jin, Z.,Liu, X.,Yang, H.,Rao, Z. (deposition date: 2020-04-08, release date: 2020-04-29, Last modification date: 2023-11-29)
Primary citation	Jin, Z.,Zhao, Y.,Sun, Y.,Zhang, B.,Wang, H.,Wu, Y.,Zhu, Y.,Zhu, C.,Hu, T.,Du, X.,Duan, Y.,Yu, J.,Yang, X.,Yang, X.,Yang, K.,Liu, X.,Guddat, L.W.,Xiao, G.,Zhang, L.,Yang, H.,Rao, Z. Structural basis for the inhibition of SARS-CoV-2 main protease by antineoplastic drug carmofur. Nat.Struct.Mol.Biol., 27:529-532, 2020 Cited by PubMed: 32382072 DOI: 10.1038/s41594-020-0440-6 PDB entries with the same primary citation
Experimental method	X-RAY DIFFRACTION (1.6 Å)

Structure validation